SCHEMBL222194

SCHEMBL222194

CCCCCCCC(=O)Oc1ccccc1S(=O)(=O)[O-].[Na+]

nearest known ligand 0.51

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 2/20 0.44
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
KDM4E B2RXH2 1/20 0.51
RECQL P46063 1/20 0.51
POLM Q9NP87 2/20 0.50
POLK Q9UBT6 2/20 0.50
POLL Q9UGP5 2/20 0.50
POLH Q9Y253 2/20 0.50
ALOX15 P16050 1/20 0.44
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL725984 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL10913561 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL29375880 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL29775577 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL725504 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL29753940 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL727223 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL179746 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL8334538 1.00 MEN1 (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL8025576 0.99 MEN1 (0.52) MEN1KMT2AKDM4ERECQLPOLM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 195 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021835-B2 Portable stain removal kit KONINKLIJKE PHILIPS N.V. (NL) 2021-06-01 US claimed
CN-108697301-B Portable decontamination suite 皇家飞利浦有限公司 2020-03-24 CN claimed
US-20190242053-A1 PORTABLE STAIN REMOVAL KIT Versuni Holding B.V. (NL) 2019-08-08 US claimed
US-8784504-B2 Carpet cleaning method BISSELL HOMECARE, INC. (US) 2014-07-22 US claimed
EP-0850296-B1 COLOR-SAFE BLEACH BOOSTERS, COMPOSITIONS AND LAUNDRY METHODS EMPLOYING SAME PROCTER & GAMBLE (US) 2011-04-27 EP claimed
US-7862623-B1 Extraction cleaning with oxidizing agent BISSELL HOMECARE, INC. (US) 2011-01-04 US claimed
EP-1141200-A1 DETERGENT COMPOSITIONS COMPRISING A PECTATE LYASE AND A BLEACH SYSTEM THE PROCTER & GAMBLE COMPANY (US) 2001-10-10 EP claimed
WO-2000042156-A9 DETERGENT COMPOSITIONS COMPRISING A PECTATE LYASE AND A BLEACH SYSTEM PROCTER & GAMBLE (US) 2001-06-28 WO claimed
WO-2000042151-A1 DETERGENT COMPOSITIONS COMPRISING A PECTATE LYASE AND A BLEACH BOOSTER THE PROCTER & GAMBLE COMPANY (US) 2000-07-20 WO claimed
WO-2000042156-A1 DETERGENT COMPOSITIONS COMPRISING A PECTATE LYASE AND A BLEACH SYSTEM THE PROCTER & GAMBLE COMPANY (US) 2000-07-20 WO claimed
US-5817614-A QUATERNARY IMINE ZWITTERIONS PROCTER & GAMBLE COMPANY (US) 1998-10-06 US claimed
EP-0850296-A1 COLOR-SAFE BLEACH BOOSTERS, COMPOSITIONS AND LAUNDRY METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 1998-07-01 EP claimed
WO-1997010323-A1 COLOR-SAFE BLEACH BOOSTERS, COMPOSITIONS AND LAUNDRY METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 1997-03-20 WO claimed
US-5576282-A ZWITTERIONIC IMINES, LOW TEMPERATURE EFFECTIVENESS THE PROCTER & GAMBLE COMPANY (US) 1996-11-19 US claimed
EP-0163417-B2 Bleach products UNILEVER NV (NL) 1996-09-18 EP claimed
EP-0147191-B1 PERFUME AND COMPOSITIONS CONTAINING PERFUME UNILEVER N.V. (NL) 1989-10-04 EP claimed
JP-8143895-A None JP disclosed
US-11313069-B2 Stain removal accessory KONINKLIJKE PHILIPS N.V. (NL) 2022-04-26 US disclosed
EP-0148148-A2 Production of sodium alkanoyloxybenzene sulfonate Monsanto Company (US) 1985-07-10 EP disclosed
EP-0137669-A1 Detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1985-04-17 EP disclosed